input word = C00043367

Metabolite InformationStructural formula
Name Certonardosterol A4
Formula C27H46O6
Mw 466.3294392
CAS RN 781646-86-4
C_ID C00043367 ,
InChIKey CGVAZDBZAZTTNH-LWZTYCQZNA-N
InChICode InChI=1S/C27H46O6/c1-14(16(3)28)6-7-15(2)17-12-19(30)24-25(17,4)11-9-21-26(5)10-8-18(29)23(32)22(26)20(31)13-27(21,24)33/h6-7,14-24,28-33H,8-13H2,1-5H3/b7-6+/t14-,15+,16-,17-,18+,19-,20+,21-,22+,23+,24-,25-,26-,27+/m1/s1
SMILES CC(/C=C/[C@@H](C)[C@H]1C[C@@H](O)[C@@H]2[C@]1(C)CC[C@@H]1[C@@]3(C)CC[C@H](O)[C@H](O)[C@@H]3[C@@H](O)C[C@]12O)[C@@H](C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Certonardoa semiregularis Ref.
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